HRID72687

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：NNc1nc(C(F)(F)F)nc(-c2ccccc2)c1-c1ccccc1

HCID10019508

4-Hydrazino-5,6-diphenyl-2-(trifluoromethyl)pyrimidine

C17H13F3N4

HCID10825530

未命名化合物

PRODUCTS

生成物

结构：CSc1nn(-c2nc(C(F)(F)F)nc(-c3ccccc3)c2-c2ccccc2)c(N)c1C(=O)Nc1ccccc1

HCID25004705

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID887

Methanol

CH4O

PROCEDURE

实验过程

A solution of 4-hydrazino-5,6-diphenyl-2-(trifluoromethyl)pyrimidine (0.2 g, 0.63 mmol) in methanol (6 ml) was heated with 2-cyano-3,3-bis(methylthio)-N-phenylacrylamide (0.5 g, 1.89 mmol), overnight, at 60-65° C. The solid that separated out was filtered and washed with isopropyl alcohol (3 ml) to yield the required product. 1H-NMR (CDCl3) δ: 1.98 (s, 3H), 6.96-7.57 (m, 15H), 7.25-7.30 (2H, D2O exchangeable), 8.86 (br, 1H, D2O exchangeable); MS m/z: 547.1 (M++1).

WORKUP

后处理

customThe solid that separated out
filtrationwas filtered
washwashed with isopropyl alcohol (3 ml)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab444bdd2748425582efe5c1b0c3886f
来源数据集: uspto-grants-2014_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08828999B2
来源说明: uspto-grants-2014_09

反应 SMILES

[NH:1]([C:3]1[C:8]([C:9]2[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=2)=[C:7]([C:15]2[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=2)[N:6]=[C:5]([C:21]([F:24])([F:23])[F:22])[N:4]=1)[NH2:2].[C:25]([C:27](=[C:37](SC)[S:38][CH3:39])[C:28]([NH:30][C:31]1[CH:36]=[CH:35][CH:34]=[CH:33][CH:32]=1)=[O:29])#[N:26]>CO>[NH2:26][C:25]1[N:1]([C:3]2[C:8]([C:9]3[CH:10]=[CH:11][CH:12]=[CH:13][CH:14]=3)=[C:7]([C:15]3[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=3)[N:6]=[C:5]([C:21]([F:24])([F:23])[F:22])[N:4]=2)[N:2]=[C:37]([S:38][CH3:39])[C:27]=1[C:28]([NH:30][C:31]1[CH:36]=[CH:35][CH:34]=[CH:33][CH:32]=1)=[O:29]